Close
4
USFDA-Insert
X

Overview of CAS 143878-29-9

Client Email Product
4CH-024214
PharmaCompass
  • Chemistry
4CH-024214
Also known as: 143878-29-9, Methyl 4-acetamido-5-chloro-2,3-dihydrobenzofuran-7-carboxylate, Ak-88301, Methyl 4-acetamido-5-chloro-2,3-dihydrobenzo[b]furan-7-carboxylate, Methyl 4-(acetylamino)-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylate, Methyl 5-chloro-4-acetamido-2,3-dihydro-1-benzofuran-7-carboxylate
Molecular Formula
C12H12ClNO4
Molecular Weight
269.681  g/mol
InChI Key
LCPRNYGRYCDBOM-UHFFFAOYSA-N

1 2D Structure

4CH-024214

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl 4-acetamido-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylate
2.1.2 InChI
InChI=1S/C12H12ClNO4/c1-6(15)14-10-7-3-4-18-11(7)8(5-9(10)13)12(16)17-2/h5H,3-4H2,1-2H3,(H,14,15)
2.1.3 InChI Key
LCPRNYGRYCDBOM-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(=O)NC1=C(C=C(C2=C1CCO2)C(=O)OC)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 143878-29-9

2. Methyl 4-acetamido-5-chloro-2,3-dihydrobenzofuran-7-carboxylate

3. Ak-88301

4. Methyl 4-acetamido-5-chloro-2,3-dihydrobenzo[b]furan-7-carboxylate

5. Methyl 4-(acetylamino)-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylate

6. Methyl 5-chloro-4-acetamido-2,3-dihydro-1-benzofuran-7-carboxylate

7. Schembl6600592

8. Ctk8c1857

9. Dtxsid90442854

10. Molport-023-333-996

11. 7068aa

12. Anw-67375

13. Mfcd22381061

14. Zinc39126966

15. Akos016006851

16. Vz32631

17. Aj-98645

18. Ds-18454

19. Ax8237404

20. Kb-256925

21. Tc-156120

22. 4ch-024214

23. Ft-0749041

24. St24047886

25. Methyl4-acetamido-5-chloro-2,3-dihydrobenzofuran-7-carboxylate

2.3 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 269.681 g/mol
Molecular Formula C12H12ClNO4
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass269.045 g/mol
Monoisotopic Mass269.045 g/mol
Topological Polar Surface Area64.6 A^2
Heavy Atom Count18
Formal Charge0
Complexity349
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty

Advertise With Us

Advertise With Us